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@deepchem @peng-lab-uiuc @MachineLearning4Chemistry


  1. Integrating Deep Neural Networks and Symbolic Inference for Organic Reactivity Prediction

    Python 5 3

  2. 🎓 Graph Matching Algorithm

    MATLAB 5

  3. 🔬 Train an Amino Acid Embeddings (or a dragon?)

    MATLAB 13 1

  4. 📑 A list of papers I particularly enjoy

    5 1

  5. An Open Source Machine Learning Framework for Everyone

    C++ 147k 82.2k

  6. Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

    Python 2.3k 769

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August 2020

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July 2020

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